6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine

C17H20N4O2 — CID 91771738

IUPAC6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine
SMILESc1ccc(O[C@@H]2CCOC[C@H]2Nc2cc(C3CC3)ncn2)nc1
InChIInChI=1S/C17H20N4O2/c1-2-7-18-17(3-1)23-15-6-8-22-10-14(15)21-16-9-13(12-4-5-12)19-11-20-16/h1-3,7,9,11-12,14-15H,4-6,8,10H2,(H,19,20,21)/t14-,15-/m1/s1
InChIKeyLGNQXPQELLNFSQ-HUUCEWRRSA-N
MW312.37 g/mol
LogP2.40
Rot. Bonds5

About 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine

6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine (PubChem CID 91771738) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine
PubChem CID91771738
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine
SMILESc1ccc(O[C@@H]2CCOC[C@H]2Nc2cc(C3CC3)ncn2)nc1
InChIInChI=1S/C17H20N4O2/c1-2-7-18-17(3-1)23-15-6-8-22-10-14(15)21-16-9-13(12-4-5-12)19-11-20-16/h1-3,7,9,11-12,14-15H,4-6,8,10H2,(H,19,20,21)/t14-,15-/m1/s1
InChIKeyLGNQXPQELLNFSQ-HUUCEWRRSA-N
XLogP2.40
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine with MolForge

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Related Compounds

N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide
CID 91761162
3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine
CID 91765729
2-[(3S,4R)-3-[(6-cyclopropylpyrimidin-4-yl)amino]oxan-4-yl]oxy-N,N-dimethylacetamide
CID 133268181
N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]-1H-pyrazole-4-carboxamide
CID 91773229
1,1-di(propan-2-yl)-3-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]urea
CID 91777188
2-phenylmethoxy-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]acetamide
CID 91761107
6-cyclopropyl-N-(1-pyridin-2-ylazetidin-3-yl)pyrimidin-4-amine
CID 154575536
3-amino-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]thiophene-2-carboxamide
CID 91764238
2-propan-2-ylsulfonyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]acetamide
CID 91766386
1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide
CID 91795536
N-[2-oxo-2-[(4-pyridin-2-yloxyoxan-3-yl)amino]ethyl]benzamide
CID 156608743
3-chloro-N-[(3S,4R)-3-pyridin-2-yloxyoxan-4-yl]pyridin-2-amine
CID 91773034

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine?
The IUPAC name of 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine (CID 91771738) is 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine.
What is the SMILES notation for 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine?
The canonical SMILES for 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine is c1ccc(O[C@@H]2CCOC[C@H]2Nc2cc(C3CC3)ncn2)nc1.
What is the InChIKey of 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine?
The InChIKey is LGNQXPQELLNFSQ-HUUCEWRRSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-2-7-18-17(3-1)23-15-6-8-22-10-14(15)21-16-9-13(12-4-5-12)19-11-20-16/h1-3,7,9,11-12,14-15H,4-6,8,10H2,(H,19,20,21)/t14-,15-/m1/s1.
What are the key properties of 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine?
6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine has a molecular weight of 312.37 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine is sourced from PubChem (CID 91771738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).